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Dihydrobrassicasterol -H2O          @
SpectraBase Compound ID 3wp2C8HspSr
InChI InChI=1S/C28H46/c1-19(2)20(3)10-11-21(4)24-14-15-25-23-13-12-22-9-7-8-17-27(22,5)26(23)16-18-28(24,25)6/h7,9,12,19-21,23-26H,8,10-11,13-18H2,1-6H3
InChIKey TZFSYLGHXUOJOH-UHFFFAOYSA-N
Mol Weight 382.7 g/mol
Molecular Formula C28H46
Exact Mass 382.359951 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LLUWmkzBbZv
Name Dihydrobrassicasterol -H2O @
Classification Plant sterol
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Exact Mass 382.359951481 u
Formula C28H46
InChI InChI=1S/C28H46/c1-19(2)20(3)10-11-21(4)24-14-15-25-23-13-12-22-9-7-8-17-27(22,5)26(23)16-18-28(24,25)6/h7,9,12,19-21,23-26H,8,10-11,13-18H2,1-6H3
InChIKey TZFSYLGHXUOJOH-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 382.676 g/mol
SMILES C12(C(C3CC=C4C(C3CC2)(CCC=C4)C)CCC1C(CCC(C(C)C)C)C)C
SPLASH splash10-0535-4911000000-7f76b75ae30fb22f1a84
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Ergost-3,5-ene Ergost-5-en-3-ol -H2O
Technique GC/MS
Wiley ID MMPW6e_5624